1-butyl-3-[(E)-(3-chlorophenyl)methylideneamino]thiourea

Systemtic Name: 1-butyl-3-[(E)-(3-chlorophenyl)methylideneamino]thiourea Openeye Name: 1-butyl-3-[(E)-(3-chlorophenyl)methyleneamino]thiourea CAS Name: 1-butyl-3-[(E)-(3-chlorophenyl)methylideneamino]thiourea IUPAC Name: 1-butyl-3-[(E)-(3-chlorophenyl)methylideneamino]thiourea Traditional Name: 1-butyl-3-[(E)-(3-chlorobenzylidene)amino]thiourea Formula: C12H16ClN3S MolecularWeight: 269.79354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=CC1=CC(=CC=C1)Cl

Isomeric SMILES

CCCCNC(=S)N/N=C/C1=CC(=CC=C1)Cl

InChI

InChI=1S/C12H16ClN3S/c1-2-3-7-14-12(17)16-15-9-10-5-4-6-11(13)8-10/h4-6,8-9H,2-3,7H2,1H3,(H2,14,16,17)/b15-9+